Ether, ethyl heptafluoroisobutenyl

Base Information

• Chemical Name: Ether, ethyl heptafluoroisobutenyl
• CAS No.: 360-58-7
• Molecular Formula: C6H5 F7 O
• Molecular Weight: 226.094
• Hs Code.: 2909199090
• DSSTox Substance ID: DTXSID30189559
• Nikkaji Number: J49.870J
• Mol file: 360-58-7.mol

Synonyms:ETHER, ETHYL HEPTAFLUOROISOBUTENYL;360-58-7;Ethyl perfluoroisobutenyl ether;Ethyl heptafluoroisobutenyl ether;1-Ethoxyperfluoroisobutylene;Perfluoroisobutenylethyl ether;BRN 1789415;Ether, ethyl tetrafluoro-2-(trifluoromethyl)propenyl;1-Propene, 1-ethoxy-1,3,3,3-tetrafluoro-2-(trifluoromethyl)-;C6H5F7O;SCHEMBL8004680;DTXSID30189559;C6-H5-F7-O;LS-67834;1-Ethoxy-1,3,3,3-tetrafluoro-2-(trifluoromethyl)-1-propene;1-Propene, 1-ethoxy-1,3,3,3-tetrafluoro-2-(trifluoromethyl)-?

Chemical Property of Ether, ethyl heptafluoroisobutenyl

Chemical Property:

• Vapor Pressure: 19.7mmHg at 25°C
• Boiling Point: 118.7°Cat760mmHg
• Flash Point: 31.2°C
• PSA: 9.23000
• Density: 1.367g/cm³
• LogP: 3.32860
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 226.02286191
• Heavy Atom Count: 14
• Complexity: 207

Purity/Quality:

99% ^*data from raw suppliers

PERFLUOROISOBUTENYLETHYL ETHER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=C(C(F)(F)F)C(F)(F)F)F

Technology Process of Ether, ethyl heptafluoroisobutenyl

There total 2 articles about Ether, ethyl heptafluoroisobutenyl which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 62.0%

ethanol (64-17-5) + perfluoroisobutylene (382-21-8) → 1-ethoxy-1,3,3,3-tetrafluoro-2-trifluoromethyl-propene (360-58-7)

Guidance literature:

ethanol; perfluoroisobutylene; at 20 ℃; for 48h; Autoclave;

With potassium hydroxide; In diethyl ether;

DOI:10.1016/j.ejmech.2009.08.007

Reference yield:

ethyl-(βH-octafluoro-isobutyl)-ether (380-30-3) → 1-ethoxy-1,3,3,3-tetrafluoro-2-trifluoromethyl-propene (360-58-7)

Guidance literature:

With potassium hydroxide; diethyl ether;

Reference yield: 90.0%

1-ethoxy-1,3,3,3-tetrafluoro-2-trifluoromethyl-propene (360-58-7) + phenylhydrazine (100-63-0) → 1-phenyl-3-ethoxy-4-trifluoromethyl-5-fluoropyrazole (132631-79-9)

Guidance literature:

With triethylamine; In ethanol;

DOI:10.1007/BF00958848

upstream raw materials:

ethyl-(βH-octafluoro-isobutyl)-ether

ethanol

perfluoroisobutylene

Downstream raw materials:

β,β,β,β',β',β'-hexafluoro-isobutyric acid anilide

3,3,3-trifluoro-2-trifluoromethylpropionyl chloride

2,2-bis(trifluoromethyl)butanoyl fluoride

1-fluoroethane

Refernces

• 1、 Luzina, Elena L.,Popov, Anatoliy V.. "Synthesis and anticancer activity of N-bis(trifluoromethyl)alkyl-N′-thiazolyl and N-bis(trifluoromethyl)alkyl-N′-benzothiazolyl ureas". experimental part. p. 4944 - 4953. Retrieved 2010/02/27.